Basic information
- CAS
761419-80-1- Standard SMILES
COc1cc(CC(=O)Nc2nc(C)cs2)cc(OC)c1OC- InChIKey
CDVDZNVUONFZES-UHFFFAOYSA-N- Molecular formula
- C15H18N2O4S
- Average molar mass
- 322.4 g/mol
- Monoisotopic mass
- 322.09872823
Names & identifiers
- Preferred name
- N-(4-methyl-1,3-thiazol-2-yl)-2-(3,4,5-trimethoxyphenyl)acetamide
- IUPAC
- N-(4-methyl-1,3-thiazol-2-yl)-2-(3,4,5-trimethoxyphenyl)acetamide
Names & synonyms
N-(4-methyl-1,3-thiazol-2-yl)-2-(3,4,5-trimethoxyphenyl)acetamideMLS001003852CHEMBL1710111DTXSID601322962HMS2726N24AKOS034143763761419-80-1SMR000377602Z30820238
Database identifiers
- CAS
761419-80-1- PubChem CID
- 2084331
- DTXSID
DTXSID601322962- ChEMBL
CHEMBL1710111
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 97.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 357
Experimental & physicochemical properties
Solubility42.9 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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